4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline
TL;DR: 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline (CAS 418785-68-9) is a chemical compound with molecular formula C12H12FNO and molecular weight 205.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-N-(furan-2-ylmethyl)-2-methylaniline
Also Known As: 4-fluoro-N-(furan-2-ylmethyl)-2-methylaniline, 4-Fluoro-N-(2-furylmethyl)-2-methylaniline, 4-fluoro-N-(2-furylmethyl)-2-methyl-aniline, 4-fluoro-N-[(furan-2-yl)methyl]-2-methylaniline, 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline
| Molecular Formula | C12H12FNO |
|---|---|
| Molecular Weight | 205.09 g/mol |
| LogP | 3.33922 |
| Topological Polar Surface Area | 25.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.09029 |
| Heavy Atoms | 15 |
| Complexity | 436.8877 |
Chemical Identifiers
| CAS Number | 418785-68-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)F)NCC2=CC=CO2 |
Product Overview
4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline (CAS 418785-68-9), with molecular formula C12H12FNO and molecular weight 205.09 g/mol. IUPAC: 4-fluoro-N-(furan-2-ylmethyl)-2-methylaniline.
Chemical Property Profile of 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline
Property Insights of 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline
The XLogP value of 3.33922 indicates that 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.17 Ų, 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline?
The CAS number of 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline is 418785-68-9.
What is the molecular formula of 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline?
The molecular formula of 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline is C12H12FNO.
What is the molecular weight of 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline?
The molecular weight of 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline is 205.09 g/mol.
Where can I buy 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline?
You can request a quote for 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-fluoro-N-((furan-2-yl)methyl)-2-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.